4210-32-6

Name 4-tert-Butylbenzonitrile
CAS 4210-32-6
EINECS(EC#) 224-137-2
Molecular Formula C11H13N
MDL Number MFCD00075840
Molecular Weight 159.23
MOL File 4210-32-6.mol
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Chemical Properties

Appearance clear colorless liquid
Melting point  12-14 °C
Boiling point  258 °C(lit.)
density  0.94 g/mL at 25 °C(lit.)
refractive index  n20/D 1.518(lit.)
Fp  >230 °F
storage temp.  Sealed in dry,Room Temperature
form  clear liquid
color  Colorless to Light yellow
Specific Gravity 0.95
BRN  2080049
InChI InChI=1S/C11H13N/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7H,1-3H3
InChIKey IIZURLNRIMKEDL-UHFFFAOYSA-N
SMILES C(#N)C1=CC=C(C(C)(C)C)C=C1
LogP 3.49
CAS DataBase Reference 4210-32-6(CAS DataBase Reference)
NIST Chemistry Reference 4-t-Butylbenzonitrile(4210-32-6)

Safety Data

Hazard Codes  Xn,Xi
Risk Statements 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
Safety Statements 
S36:Wear suitable protective clothing .
S36/37:Wear suitable protective clothing and gloves .
RIDADR  3276
WGK Germany  2
Hazard Note  Irritant
REACH Registrations Active
HazardClass  6.1
PackingGroup  III
HS Code  29269090
Storage Class 10 - Combustible liquids
Hazard Classifications Acute Tox. 4 Oral

Hazard Information

Material Safety Data Sheet(MSDS)

Spectrum Detail

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